Found 50 hits Enz. Inhib. hit(s) with all data for entry = 50026960 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253559
(4-Hydroxy-1-(toluene-4-sulfonyl)-pyrrolidine-2-car...)Show SMILES Cc1ccc(cc1)S(=O)(=O)N1C[C@H](O)C[C@H]1C(=O)NO |r| Show InChI InChI=1S/C12H16N2O5S/c1-8-2-4-10(5-3-8)20(18,19)14-7-9(15)6-11(14)12(16)13-17/h2-5,9,11,15,17H,6-7H2,1H3,(H,13,16)/t9-,11+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253560
(1-Benzenesulfonyl-4-hydroxy-pyrrolidine-2-carboxyl...)Show SMILES ONC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C11H14N2O5S/c14-8-6-10(11(15)12-16)13(7-8)19(17,18)9-4-2-1-3-5-9/h1-5,8,10,14,16H,6-7H2,(H,12,15)/t8-,10+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253304
(1-(Toluene-4-sulfonyl)-4-(toluene-4-sulfonyloxy)-p...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OS(=O)(=O)c1ccc(C)cc1 |r| Show InChI InChI=1S/C20H23NO7S2/c1-14-4-8-17(9-5-14)29(23,24)21-13-16(12-19(21)20(22)27-3)28-30(25,26)18-10-6-15(2)7-11-18/h4-11,16,19H,12-13H2,1-3H3/t16-,19+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50247539
(CHEMBL472915 | N-((3S,5S)-1-((E)-3-(3,4-dimethoxyp...)Show SMILES COc1ccc(\C=C\C(=O)N2C[C@H](C[C@H]2C(=O)NO)NC(=O)c2cccnc2)cc1OC |r| Show InChI InChI=1S/C22H24N4O6/c1-31-18-7-5-14(10-19(18)32-2)6-8-20(27)26-13-16(11-17(26)22(29)25-30)24-21(28)15-4-3-9-23-12-15/h3-10,12,16-17,30H,11,13H2,1-2H3,(H,24,28)(H,25,29)/b8-6+/t16-,17-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253481
(1-Benzenesulfonyl-4-benzenesulfonyloxy-pyrrolidine...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OS(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C18H19NO7S2/c1-25-18(20)17-12-14(26-28(23,24)16-10-6-3-7-11-16)13-19(17)27(21,22)15-8-4-2-5-9-15/h2-11,14,17H,12-13H2,1H3/t14-,17+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253561
(4-Hydroxy-1-methanesulfonyl-pyrrolidine-2-carboxyl...)Show InChI InChI=1S/C6H12N2O5S/c1-14(12,13)8-3-4(9)2-5(8)6(10)7-11/h4-5,9,11H,2-3H2,1H3,(H,7,10)/t4-,5+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253480
(1-Benzenesulfonyl-4-(toluene-4-sulfonyloxy)-pyrrol...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OS(=O)(=O)c1ccc(C)cc1 |r| Show InChI InChI=1S/C19H21NO7S2/c1-14-8-10-17(11-9-14)29(24,25)27-15-12-18(19(21)26-2)20(13-15)28(22,23)16-6-4-3-5-7-16/h3-11,15,18H,12-13H2,1-2H3/t15-,18+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253340
(4-(3-Phenyl-acryloyloxy)-1-(toluene-4-sulfonyl)-py...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OC(=O)\C=C\c1ccccc1 |r| Show InChI InChI=1S/C22H23NO6S/c1-16-8-11-19(12-9-16)30(26,27)23-15-18(14-20(23)22(25)28-2)29-21(24)13-10-17-6-4-3-5-7-17/h3-13,18,20H,14-15H2,1-2H3/b13-10+/t18-,20+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253305
(4-Benzenesulfonyloxy-1-(toluene-4-sulfonyl)-pyrrol...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OS(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C19H21NO7S2/c1-14-8-10-16(11-9-14)28(22,23)20-13-15(12-18(20)19(21)26-2)27-29(24,25)17-6-4-3-5-7-17/h3-11,15,18H,12-13H2,1-2H3/t15-,18+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253531
(1-Benzenesulfonyl-4-(3-phenyl-acryloyloxy)-pyrroli...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OC(=O)\C=C\c1ccccc1 |r| Show InChI InChI=1S/C21H21NO6S/c1-27-21(24)19-14-17(28-20(23)13-12-16-8-4-2-5-9-16)15-22(19)29(25,26)18-10-6-3-7-11-18/h2-13,17,19H,14-15H2,1H3/b13-12+/t17-,19+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253922
(4-Hydroxy-1-(toluene-4-sulfonyl)-pyrrolidine-2-car...)Show SMILES COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(C)cc1 |r| Show InChI InChI=1S/C13H17NO5S/c1-9-3-5-11(6-4-9)20(17,18)14-8-10(15)7-12(14)13(16)19-2/h3-6,10,12,15H,7-8H2,1-2H3/t10-,12+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253306
(4-Methanesulfonyloxy-1-(toluene-4-sulfonyl)-pyrrol...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OS(C)(=O)=O |r| Show InChI InChI=1S/C14H19NO7S2/c1-10-4-6-12(7-5-10)24(19,20)15-9-11(22-23(3,17)18)8-13(15)14(16)21-2/h4-7,11,13H,8-9H2,1-3H3/t11-,13+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253534
(1-Methanesulfonyl-4-(toluene-4-sulfonyloxy)-pyrrol...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OS(=O)(=O)c1ccc(C)cc1 |r| Show InChI InChI=1S/C14H19NO7S2/c1-10-4-6-12(7-5-10)24(19,20)22-11-8-13(14(16)21-2)15(9-11)23(3,17)18/h4-7,11,13H,8-9H2,1-3H3/t11-,13+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253558
(1-Methanesulfonyl-4-(3-phenyl-acryloyloxy)-pyrroli...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OC(=O)\C=C\c1ccccc1 |r| Show InChI InChI=1S/C16H19NO6S/c1-22-16(19)14-10-13(11-17(14)24(2,20)21)23-15(18)9-8-12-6-4-3-5-7-12/h3-9,13-14H,10-11H2,1-2H3/b9-8+/t13-,14+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253535
(4-Benzenesulfonyloxy-1-methanesulfonyl-pyrrolidine...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OS(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C13H17NO7S2/c1-20-13(15)12-8-10(9-14(12)22(2,16)17)21-23(18,19)11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3/t10-,12+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253923
(1-Benzenesulfonyl-4-hydroxy-pyrrolidine-2-carboxyl...)Show SMILES COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C12H15NO5S/c1-18-12(15)11-7-9(14)8-13(11)19(16,17)10-5-3-2-4-6-10/h2-6,9,11,14H,7-8H2,1H3/t9-,11+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 800 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253482
(1-Benzenesulfonyl-4-methanesulfonyloxy-pyrrolidine...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OS(C)(=O)=O |r| Show InChI InChI=1S/C13H17NO7S2/c1-20-13(15)12-8-10(21-22(2,16)17)9-14(12)23(18,19)11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3/t10-,12+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253533
(4-(4-Chloro-benzoyloxy)-1-methanesulfonyl-pyrrolid...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OC(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C14H16ClNO6S/c1-21-14(18)12-7-11(8-16(12)23(2,19)20)22-13(17)9-3-5-10(15)6-4-9/h3-6,11-12H,7-8H2,1-2H3/t11-,12+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253303
(4-(4-Chloro-benzoyloxy)-1-(toluene-4-sulfonyl)-pyr...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OC(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C20H20ClNO6S/c1-13-3-9-17(10-4-13)29(25,26)22-12-16(11-18(22)20(24)27-2)28-19(23)14-5-7-15(21)8-6-14/h3-10,16,18H,11-12H2,1-2H3/t16-,18+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253479
(1-Benzenesulfonyl-4-(4-chloro-benzoyloxy)-pyrrolid...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OC(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C19H18ClNO6S/c1-26-19(23)17-11-15(27-18(22)13-7-9-14(20)10-8-13)12-21(17)28(24,25)16-5-3-2-4-6-16/h2-10,15,17H,11-12H2,1H3/t15-,17+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253302
(4-Benzoyloxy-1-(toluene-4-sulfonyl)-pyrrolidine-2-...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H21NO6S/c1-14-8-10-17(11-9-14)28(24,25)21-13-16(12-18(21)20(23)26-2)27-19(22)15-6-4-3-5-7-15/h3-11,16,18H,12-13H2,1-2H3/t16-,18+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253478
(1-Benzenesulfonyl-4-benzoyloxy-pyrrolidine-2-carbo...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C19H19NO6S/c1-25-19(22)17-12-15(26-18(21)14-8-4-2-5-9-14)13-20(17)27(23,24)16-10-6-3-7-11-16/h2-11,15,17H,12-13H2,1H3/t15-,17+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253532
(4-Benzoyloxy-1-methanesulfonyl-pyrrolidine-2-carbo...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C14H17NO6S/c1-20-14(17)12-8-11(9-15(12)22(2,18)19)21-13(16)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3/t11-,12+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253924
(4-Hydroxy-1-methanesulfonyl-pyrrolidine-2-carboxyl...)Show InChI InChI=1S/C7H13NO5S/c1-13-7(10)6-3-5(9)4-8(6)14(2,11)12/h5-6,9H,3-4H2,1-2H3/t5-,6+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50253536
(1-Methanesulfonyl-4-methanesulfonyloxy-pyrrolidine...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OS(C)(=O)=O |r| Show InChI InChI=1S/C8H15NO7S2/c1-15-8(10)7-4-6(16-18(3,13)14)5-9(7)17(2,11)12/h6-7H,4-5H2,1-3H3/t6-,7+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 (unknown origin) by microtiter plate fluorimetric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253559
(4-Hydroxy-1-(toluene-4-sulfonyl)-pyrrolidine-2-car...)Show SMILES Cc1ccc(cc1)S(=O)(=O)N1C[C@H](O)C[C@H]1C(=O)NO |r| Show InChI InChI=1S/C12H16N2O5S/c1-8-2-4-10(5-3-8)20(18,19)14-7-9(15)6-11(14)12(16)13-17/h2-5,9,11,15,17H,6-7H2,1H3,(H,13,16)/t9-,11+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.17E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253302
(4-Benzoyloxy-1-(toluene-4-sulfonyl)-pyrrolidine-2-...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C20H21NO6S/c1-14-8-10-17(11-9-14)28(24,25)21-13-16(12-18(21)20(23)26-2)27-19(22)15-6-4-3-5-7-15/h3-11,16,18H,12-13H2,1-2H3/t16-,18+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253561
(4-Hydroxy-1-methanesulfonyl-pyrrolidine-2-carboxyl...)Show InChI InChI=1S/C6H12N2O5S/c1-14(12,13)8-3-4(9)2-5(8)6(10)7-11/h4-5,9,11H,2-3H2,1H3,(H,7,10)/t4-,5+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.63E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253535
(4-Benzenesulfonyloxy-1-methanesulfonyl-pyrrolidine...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OS(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C13H17NO7S2/c1-20-13(15)12-8-10(9-14(12)22(2,16)17)21-23(18,19)11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3/t10-,12+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.84E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253536
(1-Methanesulfonyl-4-methanesulfonyloxy-pyrrolidine...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OS(C)(=O)=O |r| Show InChI InChI=1S/C8H15NO7S2/c1-15-8(10)7-4-6(16-18(3,13)14)5-9(7)17(2,11)12/h6-7H,4-5H2,1-3H3/t6-,7+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.16E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253560
(1-Benzenesulfonyl-4-hydroxy-pyrrolidine-2-carboxyl...)Show SMILES ONC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C11H14N2O5S/c14-8-6-10(11(15)12-16)13(7-8)19(17,18)9-4-2-1-3-5-9/h1-5,8,10,14,16H,6-7H2,(H,12,15)/t8-,10+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.35E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253479
(1-Benzenesulfonyl-4-(4-chloro-benzoyloxy)-pyrrolid...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OC(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C19H18ClNO6S/c1-26-19(23)17-11-15(27-18(22)13-7-9-14(20)10-8-13)12-21(17)28(24,25)16-5-3-2-4-6-16/h2-10,15,17H,11-12H2,1H3/t15-,17+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.64E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253922
(4-Hydroxy-1-(toluene-4-sulfonyl)-pyrrolidine-2-car...)Show SMILES COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(C)cc1 |r| Show InChI InChI=1S/C13H17NO5S/c1-9-3-5-11(6-4-9)20(17,18)14-8-10(15)7-12(14)13(16)19-2/h3-6,10,12,15H,7-8H2,1-2H3/t10-,12+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.84E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253482
(1-Benzenesulfonyl-4-methanesulfonyloxy-pyrrolidine...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OS(C)(=O)=O |r| Show InChI InChI=1S/C13H17NO7S2/c1-20-13(15)12-8-10(21-22(2,16)17)9-14(12)23(18,19)11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3/t10-,12+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253306
(4-Methanesulfonyloxy-1-(toluene-4-sulfonyl)-pyrrol...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OS(C)(=O)=O |r| Show InChI InChI=1S/C14H19NO7S2/c1-10-4-6-12(7-5-10)24(19,20)15-9-11(22-23(3,17)18)8-13(15)14(16)21-2/h4-7,11,13H,8-9H2,1-3H3/t11-,13+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.14E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253924
(4-Hydroxy-1-methanesulfonyl-pyrrolidine-2-carboxyl...)Show InChI InChI=1S/C7H13NO5S/c1-13-7(10)6-3-5(9)4-8(6)14(2,11)12/h5-6,9H,3-4H2,1-2H3/t5-,6+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.16E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253478
(1-Benzenesulfonyl-4-benzoyloxy-pyrrolidine-2-carbo...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C19H19NO6S/c1-25-19(22)17-12-15(26-18(21)14-8-4-2-5-9-14)13-20(17)27(23,24)16-10-6-3-7-11-16/h2-11,15,17H,12-13H2,1H3/t15-,17+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253481
(1-Benzenesulfonyl-4-benzenesulfonyloxy-pyrrolidine...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OS(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C18H19NO7S2/c1-25-18(20)17-12-14(26-28(23,24)16-10-6-3-7-11-16)13-19(17)27(21,22)15-8-4-2-5-9-15/h2-11,14,17H,12-13H2,1H3/t14-,17+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.73E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253533
(4-(4-Chloro-benzoyloxy)-1-methanesulfonyl-pyrrolid...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OC(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C14H16ClNO6S/c1-21-14(18)12-7-11(8-16(12)23(2,19)20)22-13(17)9-3-5-10(15)6-4-9/h3-6,11-12H,7-8H2,1-2H3/t11-,12+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.75E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253303
(4-(4-Chloro-benzoyloxy)-1-(toluene-4-sulfonyl)-pyr...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OC(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C20H20ClNO6S/c1-13-3-9-17(10-4-13)29(25,26)22-12-16(11-18(22)20(24)27-2)28-19(23)14-5-7-15(21)8-6-14/h3-10,16,18H,11-12H2,1-2H3/t16-,18+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.12E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253532
(4-Benzoyloxy-1-methanesulfonyl-pyrrolidine-2-carbo...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OC(=O)c1ccccc1 |r| Show InChI InChI=1S/C14H17NO6S/c1-20-14(17)12-8-11(9-15(12)22(2,18)19)21-13(16)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3/t11-,12+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.36E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253923
(1-Benzenesulfonyl-4-hydroxy-pyrrolidine-2-carboxyl...)Show SMILES COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C12H15NO5S/c1-18-12(15)11-7-9(14)8-13(11)19(16,17)10-5-3-2-4-6-10/h2-6,9,11,14H,7-8H2,1H3/t9-,11+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253480
(1-Benzenesulfonyl-4-(toluene-4-sulfonyloxy)-pyrrol...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OS(=O)(=O)c1ccc(C)cc1 |r| Show InChI InChI=1S/C19H21NO7S2/c1-14-8-10-17(11-9-14)29(24,25)27-15-12-18(19(21)26-2)20(13-15)28(22,23)16-6-4-3-5-7-16/h3-11,15,18H,12-13H2,1-2H3/t15-,18+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.13E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253534
(1-Methanesulfonyl-4-(toluene-4-sulfonyloxy)-pyrrol...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OS(=O)(=O)c1ccc(C)cc1 |r| Show InChI InChI=1S/C14H19NO7S2/c1-10-4-6-12(7-5-10)24(19,20)22-11-8-13(14(16)21-2)15(9-11)23(3,17)18/h4-7,11,13H,8-9H2,1-3H3/t11-,13+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.89E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253305
(4-Benzenesulfonyloxy-1-(toluene-4-sulfonyl)-pyrrol...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OS(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C19H21NO7S2/c1-14-8-10-16(11-9-14)28(22,23)20-13-15(12-18(20)19(21)26-2)27-29(24,25)17-6-4-3-5-7-17/h3-11,15,18H,12-13H2,1-2H3/t15-,18+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.46E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253304
(1-(Toluene-4-sulfonyl)-4-(toluene-4-sulfonyloxy)-p...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OS(=O)(=O)c1ccc(C)cc1 |r| Show InChI InChI=1S/C20H23NO7S2/c1-14-4-8-17(9-5-14)29(23,24)21-13-16(12-19(21)20(22)27-3)28-30(25,26)18-10-6-15(2)7-11-18/h4-11,16,19H,12-13H2,1-3H3/t16-,19+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.01E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253558
(1-Methanesulfonyl-4-(3-phenyl-acryloyloxy)-pyrroli...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(C)(=O)=O)OC(=O)\C=C\c1ccccc1 |r| Show InChI InChI=1S/C16H19NO6S/c1-22-16(19)14-10-13(11-17(14)24(2,20)21)23-15(18)9-8-12-6-4-3-5-7-12/h3-9,13-14H,10-11H2,1-2H3/b9-8+/t13-,14+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.14E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253531
(1-Benzenesulfonyl-4-(3-phenyl-acryloyloxy)-pyrroli...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccccc1)OC(=O)\C=C\c1ccccc1 |r| Show InChI InChI=1S/C21H21NO6S/c1-27-21(24)19-14-17(28-20(23)13-12-16-8-4-2-5-9-16)15-22(19)29(25,26)18-10-6-3-7-11-18/h2-13,17,19H,14-15H2,1H3/b13-12+/t17-,19+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.35E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50247539
(CHEMBL472915 | N-((3S,5S)-1-((E)-3-(3,4-dimethoxyp...)Show SMILES COc1ccc(\C=C\C(=O)N2C[C@H](C[C@H]2C(=O)NO)NC(=O)c2cccnc2)cc1OC |r| Show InChI InChI=1S/C22H24N4O6/c1-31-18-7-5-14(10-19(18)32-2)6-8-20(27)26-13-16(11-17(26)22(29)25-30)24-21(28)15-4-3-9-23-12-15/h3-10,12,16-17,30H,11,13H2,1-2H3,(H,24,28)(H,25,29)/b8-6+/t16-,17-/m0/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.42E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
Aminopeptidase N
(Homo sapiens (Human)) | BDBM50253340
(4-(3-Phenyl-acryloyloxy)-1-(toluene-4-sulfonyl)-py...)Show SMILES COC(=O)[C@@H]1C[C@H](CN1S(=O)(=O)c1ccc(C)cc1)OC(=O)\C=C\c1ccccc1 |r| Show InChI InChI=1S/C22H23NO6S/c1-16-8-11-19(12-9-16)30(26,27)23-15-18(14-20(23)22(25)28-2)29-21(24)13-10-17-6-4-3-5-7-17/h3-13,18,20H,14-15H2,1-2H3/b13-10+/t18-,20+/m1/s1 | PDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.69E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of APN (unknown origin) by spectrophotometric assay |
Bioorg Med Chem 16: 7932-8 (2008)
Article DOI: 10.1016/j.bmc.2008.07.073
BindingDB Entry DOI: 10.7270/Q2MP533K |
More data for this
Ligand-Target Pair | |
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